baumycins
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baumycins
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CAS No:
64314-28-9
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Formula:
C34H43NO13
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Chemical Name:
baumycins
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Synonyms:
baumycins;baumycins, baumycin A2;baumycins, baumycin B1;baumycins, baumycin B2;baumycins, baumycin C1;baumycins, baumycin C2;Baumycin A1;5,12-Naphthacenedione, 8-acetyl-10-((3-amino-2,3,6-trideoxy-4-O-(3-hydroxy-1-(2-hydroxy-1-methylethoxy)butyl)-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-, (8S-cis)-;(7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-[3-hydroxy-1-(1-hydroxypropan-2-yloxy)butoxy]-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
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CAS No:
Characteristics
225
2.2
1.2794 (rough estimate)
183.5°C
Peritoneal-mouse LD50: 1.5 mg/kg
Flammable; burning produces toxic nitrogen oxide fumes
Safety Information
Ventilated, low temperature and dry; stored separately from food materials in warehouse
Computed Properties
Molecular Weight:673.7
XLogP3:2.2
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:11
Exact Mass:673.27344043
Monoisotopic Mass:673.27344043
Topological Polar Surface Area:225
Heavy Atom Count:48
Complexity:1170
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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